[2-(furan-2-yl)-6-oxidanyl-4-oxidanylidene-chromen-5-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [2-(furan-2-yl)-6-oxidanyl-4-oxidanylidene-chromen-5-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[2-(2-furyl)-6-hydroxy-4-oxo-chromen-5-yl]methyl]-methyl-ammonium CAS Name: [2-(2-furanyl)-6-hydroxy-4-oxo-1-benzopyran-5-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[2-(furan-2-yl)-6-hydroxy-4-oxochromen-5-yl]methyl]-methylazanium Traditional Name: benzyl-[[2-(2-furyl)-6-hydroxy-4-keto-chromen-5-yl]methyl]-methyl-ammonium Formula: C22H20NO4+ MolecularWeight: 362.3985

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2C(=O)C=C(O3)C4=CC=CO4)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2C(=O)C=C(O3)C4=CC=CO4)O

InChI

InChI=1S/C22H19NO4/c1-23(13-15-6-3-2-4-7-15)14-16-17(24)9-10-20-22(16)18(25)12-21(27-20)19-8-5-11-26-19/h2-12,24H,13-14H2,1H3/p+1